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| Related CAS: | 1215268-18-0 (Deleted CAS) |
| IUPAC Name: | 2-[[(3aR,4S,6R,6aS)-6-[7-[[(1R,2S)-2-(3,4-difluorophenyl)cyclopropyl]amino]-5-propylsulfanyltriazolo[4,5-d]pyrimidin-3-yl]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl]oxy]ethanol |
| Description: | Ticagrelor EP Impurity D is an impurity of Ticagrelor, which is a reversible P2Y12 receptor antagonist used for the prevention of stroke, heart attack and other events in people with acute coronary syndrome, meaning problems with blood supply in the coronary arteries. |
| Molecular Weight: | 562.63 |
| Molecular Formula: | C26H32F2N6O4S |
| Canonical SMILES: | CCCSC1=NC(=C2C(=N1)N(N=N2)C3CC(C4C3OC(O4)(C)C)OCCO)NC5CC5C6=CC(=C(C=C6)F)F |
| InChI: | InChI=1S/C26H32F2N6O4S/c1-4-9-39-25-30-23(29-17-11-14(17)13-5-6-15(27)16(28)10-13)20-24(31-25)34(33-32-20)18-12-19(36-8-7-35)22-21(18)37-26(2,3)38-22/h5-6,10,14,17-19,21-22,35H,4,7-9,11-12H2,1-3H3,(H,29,30,31)/t14-,17+,18+,19-,21-,22+/m0/s1 |
| InChI Key: | WLEOHEIRUFTYCF-FYEBJQQMSA-N |
| Boiling Point: | 759.1±70.0°C at 760 mmHg |
| Melting Point: | 52-60°C |
| Purity: | ≥95% |
| Density: | 1.59±0.1 g/cm3 at 20°C, 760 Torr |
| Solubility: | Soluble in Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly) |
| Appearance: | White to Pale Beige Sticky Solid to Solid |
| Storage: | Store at -20°C |
| LogP: | 3.88500 |
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